(3-acetamido-7-ethyl-5-oxidanylidene-icosanoyl)-[3-(methylamino)propanoyl]phosphinous acid

Systemtic Name: (3-acetamido-7-ethyl-5-oxidanylidene-icosanoyl)-[3-(methylamino)propanoyl]phosphinous acid Openeye Name: (3-acetamido-7-ethyl-5-oxo-icosanoyl)-[3-(methylamino)propanoyl]phosphinous acid CAS Name: (3-acetamido-7-ethyl-1,5-dioxoeicosyl)-[3-(methylamino)-1-oxopropyl]phosphinous acid IUPAC Name: (3-acetamido-7-ethyl-5-oxoicosanoyl)-[3-(methylamino)propanoyl]phosphinous acid Traditional Name: (3-acetamido-7-ethyl-5-keto-eicosanoyl)-[3-(methylamino)propanoyl]phosphinous acid Formula: C28H53N2O5P MolecularWeight: 528.704581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC)CC(=O)CC(CC(=O)P(C(=O)CCNC)O)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCC(CC)CC(=O)CC(CC(=O)P(C(=O)CCNC)O)NC(=O)C

InChI

InChI=1S/C28H53N2O5P/c1-5-7-8-9-10-11-12-13-14-15-16-17-24(6-2)20-26(32)21-25(30-23(3)31)22-28(34)36(35)27(33)18-19-29-4/h24-25,29,35H,5-22H2,1-4H3,(H,30,31)